SCHEMBL6209265

SCHEMBL6209265

CC(C)(C)N(S)C(=O)NC(CO)Cc1cscn1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.33
CAPN1 P07384 1/20 0.33
CTSK P43235 2/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
GPR142 Q7Z601 1/20 0.32
SCN9A Q15858 1/20 0.31
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
OPRD1 P41143 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
PTPRB P23467 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6212275 1.00 FOLH1 (0.33) FOLH1CAPN1CTSKCTSBCTSS
SCHEMBL6211048 0.78 NLRP3 (0.33)
SCHEMBL8245755 0.78 SCN9A (0.44) CTSKCTSSSCN9APTPRB
SCHEMBL6747611 0.78 SCN9A (0.44) CTSKCTSSSCN9APTPRB
SCHEMBL6191559 0.77 CAPN1 (0.40) FOLH1CAPN1CTSKCTSBCTSS
SCHEMBL6209741 0.76 CYP3A4 (0.36)
SCHEMBL6211338 0.75 POLB (0.31)
SCHEMBL6212924 0.72 CNR1 (0.44) FOLH1MAPK1OPRD1
SCHEMBL6209687 0.72 CNR1 (0.44) FOLH1MAPK1OPRD1
SCHEMBL27504467 0.71 FOLH1 (0.33) FOLH1CAPN1CTSKCTSBCTSS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1299365-B1 2-AMINOTHIAZOLINE DERIVATIVES AND THEIR USE AS NO-SYNTHASE INHIBITORS AVENTIS PHARMA SA (FR) 2005-09-28 EP disclosed